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2-(2-HYDROXYPENTYL)-5-CARBOXY-7-METHOXYCHROMONE
SpectraBase Compound ID 7xdTH0XbD1Y
InChI InChI=1S/C16H18O6/c1-3-4-9(17)5-11-7-13(18)15-12(16(19)20)6-10(21-2)8-14(15)22-11/h6-9,17H,3-5H2,1-2H3,(H,19,20)
InChIKey XSFAYPJLJAJJPJ-UHFFFAOYSA-N
Mol Weight 306.31 g/mol
Molecular Formula C16H18O6
Exact Mass 306.110338 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1rM3T4qV7WQ
Name 2-(2-HYDROXYPENTYL)-5-CARBOXY-7-METHOXYCHROMONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H18O6
InChI InChI=1S/C16H18O6/c1-3-4-9(17)5-11-7-13(18)15-12(16(19)20)6-10(21-2)8-14(15)22-11/h6-9,17H,3-5H2,1-2H3,(H,19,20)
InChIKey XSFAYPJLJAJJPJ-UHFFFAOYSA-N
Literature Reference Author J.CONRAD,B.FOERSTER-FROMME,M.A.CONSTANTIN,V.ONDRUS,S.MIKA,F. MERT-BALCI,I.KLAIBER
Literature Reference Citation J.NAT.PROD.,72,835(2009)
Literature Reference DOI 10.1021/np800769g
Molecular Weight 306.315 g/mol
Sample ID 32529
Solvent DMSO-D6